(2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-phenylmethoxyphenyl)propanamide

Systemtic Name: (2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-phenylmethoxyphenyl)propanamide Openeye Name: (2R)-N-(4-benzyloxyphenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide CAS Name: (2R)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]-N-(4-phenylmethoxyphenyl)propanamide IUPAC Name: (2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-phenylmethoxyphenyl)propanamide Traditional Name: (2R)-N-(4-benzoxyphenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propionamide Formula: C23H26N3O2+ MolecularWeight: 376.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)[N+]3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)[N+]3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C23H25N3O2/c1-18(26-15-13-21(14-16-26)25(2)3)23(27)24-20-9-11-22(12-10-20)28-17-19-7-5-4-6-8-19/h4-16,18H,17H2,1-3H3/p+1/t18-/m1/s1